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Compile Data Set for Download or QSAR

Found 5 hits of ph data with Target = 'Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens)
BDBM207838
PNG
(US9266828, A)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)N=C(N)N)C(=O)NCc1ccc(cc1)C(N)=N
Show InChI InChI=1S/C31H46N12O4/c1-17(2)25(43-28(46)23(40-18(3)44)5-4-14-38-30(34)35)29(47)42-24(15-19-8-12-22(13-9-19)41-31(36)37)27(45)39-16-20-6-10-21(11-7-20)26(32)33/h6-13,17,23-25H,4-5,14-16H2,1-3H3,(H3,32,33)(H,39,45)(H,40,44)(H,42,47)(H,43,46)(H4,34,35,38)(H4,36,37,41)/t23-,24-,25-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 7n/an/an/an/a7.5310.15



SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE

US Patent


Assay Description
Furin activity was measured in triplicate in wells of a 96-well plate in 0.2 ml 50 mM HEPES, pH 7.5, containing 1 mM CaCl2, 0.005% Brij-35 and 20% gl...


US Patent US9266828 (2016)


BindingDB Entry DOI: 10.7270/Q26T0KFM
More data for this
Ligand-Target Pair
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens)
BDBM207839
PNG
(US9266828, B)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)N=C(N)N)C(=O)NCc1ccc(C(N)=N)c(F)c1
Show InChI InChI=1S/C31H45FN12O4/c1-16(2)25(44-28(47)23(41-17(3)45)5-4-12-39-30(35)36)29(48)43-24(14-18-6-9-20(10-7-18)42-31(37)38)27(46)40-15-19-8-11-21(26(33)34)22(32)13-19/h6-11,13,16,23-25H,4-5,12,14-15H2,1-3H3,(H3,33,34)(H,40,46)(H,41,45)(H,43,48)(H,44,47)(H4,35,36,39)(H4,37,38,42)/t23-,24-,25-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 3.70n/an/an/an/a7.5310.15



SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE

US Patent


Assay Description
Furin activity was measured in triplicate in wells of a 96-well plate in 0.2 ml 50 mM HEPES, pH 7.5, containing 1 mM CaCl2, 0.005% Brij-35 and 20% gl...


US Patent US9266828 (2016)


BindingDB Entry DOI: 10.7270/Q26T0KFM
More data for this
Ligand-Target Pair
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens)
BDBM207842
PNG
(US9266828, E)
Show SMILES CC(C)[C@H](NS(=O)(=O)Cc1ccc(cc1)C(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCc1ccc(cc1)C(N)=N
Show InChI InChI=1S/C27H40N10O4S/c1-16(2)22(37-42(40,41)15-18-7-11-20(12-8-18)24(30)31)26(39)36-21(4-3-13-34-27(32)33)25(38)35-14-17-5-9-19(10-6-17)23(28)29/h5-12,16,21-22,37H,3-4,13-15H2,1-2H3,(H3,28,29)(H3,30,31)(H,35,38)(H,36,39)(H4,32,33,34)/t21-,22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 300n/an/an/an/a7.5310.15



SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE

US Patent


Assay Description
Furin activity was measured in triplicate in wells of a 96-well plate in 0.2 ml 50 mM HEPES, pH 7.5, containing 1 mM CaCl2, 0.005% Brij-35 and 20% gl...


US Patent US9266828 (2016)


BindingDB Entry DOI: 10.7270/Q26T0KFM
More data for this
Ligand-Target Pair
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens)
BDBM207841
PNG
(US9266828, D)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)N=C(N)N)C(=O)NCc1ccc(cc1)C(\N)=N\O
Show InChI InChI=1S/C31H46N12O5/c1-17(2)25(42-28(46)23(39-18(3)44)5-4-14-37-30(33)34)29(47)41-24(15-19-8-12-22(13-9-19)40-31(35)36)27(45)38-16-20-6-10-21(11-7-20)26(32)43-48/h6-13,17,23-25,48H,4-5,14-16H2,1-3H3,(H2,32,43)(H,38,45)(H,39,44)(H,41,47)(H,42,46)(H4,33,34,37)(H4,35,36,40)/t23-,24-,25-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.20E+3n/an/an/an/a7.5310.15



SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE

US Patent


Assay Description
Furin activity was measured in triplicate in wells of a 96-well plate in 0.2 ml 50 mM HEPES, pH 7.5, containing 1 mM CaCl2, 0.005% Brij-35 and 20% gl...


US Patent US9266828 (2016)


BindingDB Entry DOI: 10.7270/Q26T0KFM
More data for this
Ligand-Target Pair
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens)
BDBM207840
PNG
(US9266828, C)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](Cc1ccc(cc1)N=C(N)N)C(=O)NCc1ccc(cc1F)C(N)=N
Show InChI InChI=1S/C31H45FN12O4/c1-16(2)25(44-28(47)23(41-17(3)45)5-4-12-39-30(35)36)29(48)43-24(13-18-6-10-21(11-7-18)42-31(37)38)27(46)40-15-20-9-8-19(26(33)34)14-22(20)32/h6-11,14,16,23-25H,4-5,12-13,15H2,1-3H3,(H3,33,34)(H,40,46)(H,41,45)(H,43,48)(H,44,47)(H4,35,36,39)(H4,37,38,42)/t23-,24-,25-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 9n/an/an/an/a7.5310.15



SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE

US Patent


Assay Description
Furin activity was measured in triplicate in wells of a 96-well plate in 0.2 ml 50 mM HEPES, pH 7.5, containing 1 mM CaCl2, 0.005% Brij-35 and 20% gl...


US Patent US9266828 (2016)


BindingDB Entry DOI: 10.7270/Q26T0KFM
More data for this
Ligand-Target Pair